# generated using pymatgen
data_Sc3Pa(Ni2Hg)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19607344
_cell_length_b   7.19607471
_cell_length_c   3.34821460
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.46107739
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Pa(Ni2Hg)2
_chemical_formula_sum   'Sc3 Pa1 Ni4 Hg2'
_cell_volume   173.22228698
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sc  Sc0  1  0.17274177  0.33401875  0.50000000  1.0
  Sc  Sc1  1  0.83401875  0.67274177  0.50000000  1.0
  Sc  Sc2  1  0.32335315  0.82335315  0.50000000  1.0
  Pa  Pa3  1  0.67025765  0.17025765  0.50000000  1.0
  Ni  Ni4  1  0.86538157  0.36538157  0.00000000  1.0
  Ni  Ni5  1  0.38543715  0.12657635  0.00000000  1.0
  Ni  Ni6  1  0.62657635  0.88543715  0.00000000  1.0
  Ni  Ni7  1  0.11403374  0.61403374  0.00000000  1.0
  Hg  Hg8  1  0.01451287  0.99368599  0.00000000  1.0
  Hg  Hg9  1  0.49368599  0.51451287  0.00000000  1.0